SCHEMBL8561100

SCHEMBL8561100

COc1cc(OCc2ccc(C)cc2)nc(S(C)(=O)=O)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
MAOB P27338 4/20 0.42
PDE2A O00408 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MAOA P21397 1/20 0.39
TXNRD1 Q16881 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
SDHB P21912 1/20 0.37
CYP19A1 P11511 2/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18689703 0.81 PDE2A (0.51) LMNASMN1; SMN2MAOBPDE2AALDH1A1
SCHEMBL8167810 0.78 PDE2A (0.48) LMNASMN1; SMN2MAOBPDE2AALDH1A1
SCHEMBL1067726 0.78 SMN1; SMN2 (1.00) LMNASMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL8558105 0.76 ALDH1A1 (0.48) LMNASMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL9899908 0.76 PDE2A (0.45) LMNASMN1; SMN2MAOBPDE2AALDH1A1
SCHEMBL8562901 0.75 SMN1; SMN2 (0.45) LMNASMN1; SMN2MAOBALDH1A1HPGD
SCHEMBL8558749 0.73 NUDT1 (0.44) LMNASMN1; SMN2HPGDCYP19A1NPC1
SCHEMBL8559618 0.73 NUDT1 (0.44) LMNASMN1; SMN2ALDH1A1HPGDL3MBTL1
SCHEMBL6561352 0.72 SMN1; SMN2 (0.78) LMNASMN1; SMN2ALDH1A1HPGDMCOLN3
SCHEMBL6638773 0.71 SMN1; SMN2 (0.65) LMNASMN1; SMN2ALDH1A1MAPTKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5726128-A Benzyloxypyrimidine derivative, processes for producing the same and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-10 US disclosed
EP-0707001-A1 Benzyloxypyrimidine derivative, processes for producing the same and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-04-17 EP disclosed